(Q106041176)

English

chrysoeriol C-glucoside

chemical compound

1,5-anhydro-1-[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-1-benzopyran-8-yl]-L-arabino-hexitol

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Statements

type of chemical entity

0 references

8C-substituted flavone

1 reference

based on heuristic

inferred from SMILES

462.1162115239999 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

1 reference

based on heuristic

inferred from InChI

5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-8-[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₂H₂₂O₁₁

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

COc1cc(-c2cc(=O)c3c(O)cc(O)c(C4OC(CO)C(O)C(O)C4O)c3o2)ccc1O

1 reference

based on heuristic

inferred from isomeric SMILES

isomeric SMILES

COc1cc(-c2cc(=O)c3c(O)cc(O)c(C4OC(CO)[C@H](O)[C@H](O)[C@H]4O)c3o2)ccc1O

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15?,18-,19-,20+,22?/m0/s1

1 reference

ChEBI release 2021-03-01

YXHFXGHAELQJGK-STYOOGKJSA-N

1 reference

ChEBI release 2021-03-01

2 references

ChEBI release 2021-03-01

matched by identifier from

YXHFXGHAELQJGK-STYOOGKJSA-N

mapping relation type

2 references

ChEBI release 2021-03-01

matched by identifier from

International Chemical Identifier

InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15?,18-,19-,20+,22?/m0/s1

UniChem compound ID

1 reference

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